(4-fluoro-1-methylnaphthalen-2-yl)methanol

C12H11FO — CID 130126429

IUPAC(4-fluoro-1-methylnaphthalen-2-yl)methanol
SMILESCc1c(CO)cc(F)c2ccccc12
InChIInChI=1S/C12H11FO/c1-8-9(7-14)6-12(13)11-5-3-2-4-10(8)11/h2-6,14H,7H2,1H3
InChIKeyTZIJJWSYTGUVIF-UHFFFAOYSA-N
MW190.22 g/mol
LogP2.78
Rot. Bonds1

About (4-fluoro-1-methylnaphthalen-2-yl)methanol

(4-fluoro-1-methylnaphthalen-2-yl)methanol (PubChem CID 130126429) has the molecular formula C12H11FO and a molecular weight of 190.22 g/mol. Its IUPAC name is (4-fluoro-1-methylnaphthalen-2-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-1-methylnaphthalen-2-yl)methanol
PubChem CID130126429
Molecular FormulaC12H11FO
Molecular Weight190.22 g/mol
Exact Mass190.08
IUPAC Name(4-fluoro-1-methylnaphthalen-2-yl)methanol
SMILESCc1c(CO)cc(F)c2ccccc12
InChIInChI=1S/C12H11FO/c1-8-9(7-14)6-12(13)11-5-3-2-4-10(8)11/h2-6,14H,7H2,1H3
InChIKeyTZIJJWSYTGUVIF-UHFFFAOYSA-N
XLogP2.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-methylnaphthalen-2-yl)methanol
CID 15054223
(5-fluoro-4-methyl-1-benzothiophen-7-yl)methanol
CID 130987115
(4,5-difluoro-2-methylphenyl)methanol;ethane
CID 154686336
(5-fluoro-1-methylnaphthalen-2-yl)methanamine
CID 115057589
(2,3,4-trimethyl-5-phenylphenyl)methanol
CID 87491208
ethane;(5-fluoro-2,4-dimethylphenyl)methanol
CID 154686554
(2,5-dimethyl-3-phenylphenyl)methanol
CID 145013293
5-(hydroxymethyl)-4-methylbenzene-1,2,3-triol
CID 123599997
(5-ethyl-4-fluoro-2-methylphenyl)methanol
CID 117276635
[2-(2-fluorophenoxy)-5-methylphenyl]methanol
CID 114054543
[3-fluoro-2-(2-fluorophenyl)phenyl]methanol
CID 46312388
(6-fluoro-7-methyl-1-benzothiophen-3-yl)methanol
CID 131197619

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-1-methylnaphthalen-2-yl)methanol?
The IUPAC name of (4-fluoro-1-methylnaphthalen-2-yl)methanol (CID 130126429) is (4-fluoro-1-methylnaphthalen-2-yl)methanol.
What is the SMILES notation for (4-fluoro-1-methylnaphthalen-2-yl)methanol?
The canonical SMILES for (4-fluoro-1-methylnaphthalen-2-yl)methanol is Cc1c(CO)cc(F)c2ccccc12.
What is the InChIKey of (4-fluoro-1-methylnaphthalen-2-yl)methanol?
The InChIKey is TZIJJWSYTGUVIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FO/c1-8-9(7-14)6-12(13)11-5-3-2-4-10(8)11/h2-6,14H,7H2,1H3.
What are the key properties of (4-fluoro-1-methylnaphthalen-2-yl)methanol?
(4-fluoro-1-methylnaphthalen-2-yl)methanol has a molecular weight of 190.22 g/mol, XLogP of 2.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-1-methylnaphthalen-2-yl)methanol is sourced from PubChem (CID 130126429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).